4-[(2,4-dichlorophenyl)methoxy]-3-iodobenzohydrazide

C14H11Cl2IN2O2 — CID 91682061

IUPAC4-[(2,4-dichlorophenyl)methoxy]-3-iodobenzohydrazide
SMILESNNC(=O)c1ccc(OCc2ccc(Cl)cc2Cl)c(I)c1
InChIInChI=1S/C14H11Cl2IN2O2/c15-10-3-1-9(11(16)6-10)7-21-13-4-2-8(5-12(13)17)14(20)19-18/h1-6H,7,18H2,(H,19,20)
InChIKeyJEJPDWGDDZCNQL-UHFFFAOYSA-N
MW437.06 g/mol
LogP3.78
Rot. Bonds4

About 4-[(2,4-dichlorophenyl)methoxy]-3-iodobenzohydrazide

4-[(2,4-dichlorophenyl)methoxy]-3-iodobenzohydrazide (PubChem CID 91682061) has the molecular formula C14H11Cl2IN2O2 and a molecular weight of 437.06 g/mol. Its IUPAC name is 4-[(2,4-dichlorophenyl)methoxy]-3-iodobenzohydrazide.

Molecular Properties

Compound Name4-[(2,4-dichlorophenyl)methoxy]-3-iodobenzohydrazide
PubChem CID91682061
Molecular FormulaC14H11Cl2IN2O2
Molecular Weight437.06 g/mol
Exact Mass435.92
IUPAC Name4-[(2,4-dichlorophenyl)methoxy]-3-iodobenzohydrazide
SMILESNNC(=O)c1ccc(OCc2ccc(Cl)cc2Cl)c(I)c1
InChIInChI=1S/C14H11Cl2IN2O2/c15-10-3-1-9(11(16)6-10)7-21-13-4-2-8(5-12(13)17)14(20)19-18/h1-6H,7,18H2,(H,19,20)
InChIKeyJEJPDWGDDZCNQL-UHFFFAOYSA-N
XLogP3.78
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.06
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 4-[(2,4-dichlorophenyl)methoxy]-3-iodobenzohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[(2-chlorophenyl)methoxy]-3-iodobenzohydrazide
CID 91682062
3,5-dichloro-4-[(2,4-dichlorophenyl)methoxy]benzohydrazide
CID 91682789
4-[(2-chloro-4-fluorophenyl)methoxy]-3-methoxybenzohydrazide
CID 91681857
3-amino-4-[(2,4-dichlorophenyl)methoxy]benzoic acid
CID 43379751
(NZ)-N-[[4-[(2,4-dichlorophenyl)methoxy]-3-iodophenyl]methylidene]hydroxylamine
CID 91681877
3-[(4-bromo-2-chlorophenoxy)methyl]-4-fluorobenzohydrazide
CID 107458149
5-chloro-2-[(2,4-dichlorophenyl)methoxy]benzoic acid
CID 8707091
4-[(2,4-dichlorophenyl)methoxy]-3-methoxy-N-pentylbenzamide
CID 7964266
(2,4-dichlorophenyl)methyl 4-iodobenzoate
CID 2387646
4-[(2-bromo-4-chlorophenoxy)methyl]-3-chlorobenzoic acid
CID 102670133
(E)-3-[4-[(2-chloro-4-fluorophenyl)methoxy]-3-iodophenyl]prop-2-enehydrazide
CID 91684841
(E)-3-[3-bromo-4-[(2,4-dichlorophenyl)methoxy]phenyl]prop-2-enehydrazide
CID 91684795

Frequently Asked Questions

What is the IUPAC name of 4-[(2,4-dichlorophenyl)methoxy]-3-iodobenzohydrazide?
The IUPAC name of 4-[(2,4-dichlorophenyl)methoxy]-3-iodobenzohydrazide (CID 91682061) is 4-[(2,4-dichlorophenyl)methoxy]-3-iodobenzohydrazide.
What is the SMILES notation for 4-[(2,4-dichlorophenyl)methoxy]-3-iodobenzohydrazide?
The canonical SMILES for 4-[(2,4-dichlorophenyl)methoxy]-3-iodobenzohydrazide is NNC(=O)c1ccc(OCc2ccc(Cl)cc2Cl)c(I)c1.
What is the InChIKey of 4-[(2,4-dichlorophenyl)methoxy]-3-iodobenzohydrazide?
The InChIKey is JEJPDWGDDZCNQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2IN2O2/c15-10-3-1-9(11(16)6-10)7-21-13-4-2-8(5-12(13)17)14(20)19-18/h1-6H,7,18H2,(H,19,20).
What are the key properties of 4-[(2,4-dichlorophenyl)methoxy]-3-iodobenzohydrazide?
4-[(2,4-dichlorophenyl)methoxy]-3-iodobenzohydrazide has a molecular weight of 437.06 g/mol, XLogP of 3.78, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2,4-dichlorophenyl)methoxy]-3-iodobenzohydrazide is sourced from PubChem (CID 91682061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).